ONO-2952 - ≥99% , Translocator protein antagonist, CAS No.895169-20-7, Translocator protein antagonist

CAS: 895169-20-7 Cat. No.: O651717 Fórmula: C22H20ClFN2O2 Peso molecular: 398.86 PubChem CID: 11524127
Disponible para pedir
CALIDAD & PUREZA ≥99%
Synonyms
ONO-2952 | ONO 2952 | UNII-ZH8CPX4YNB | ETHANONE, 1-((1'S)-1'-(4-CHLORO-2-METHOXYPHENYL)-5'-FLUORO-1',2',3',9'-TETRAHYDROSPIRO(CYCLOPROPANE-1,4'-(4H)PYRIDO(3,4-B)INDOL)-2'-YL)- | MS-26749 | ZH8CPX4YNB | 1-((1S)-1-(4-CHLORO-2-METHOXYPHENYL)-5-FLUORO-1,9-DI
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
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Talla
USA
Alemania (EU)*
Precio
Cantidad
5mg
O651717-5mg
Fabricado bajo pedido · 8–12 semanas
1.900,90US$
10mg
O651717-10mg
Fabricado bajo pedido · 8–12 semanas
3.200,90US$
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Por qué esta calidad

≥99% para flujos de trabajo cromatográficos y analíticos sensibles que requieren una interferencia mínima de la línea base.

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Almacenamiento y envío

Store at -20°C Envío Ice chest + Ice pads. Consulte el COA específico del lote para conocer las especificaciones exactas.

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Prueba documental

Citado en 0 publicaciones revisadas por pares sobre cromatografía, síntesis orgánica y reacciones de acoplamiento cruzado.

Descripción general

ONO-2952 is a potent, selective and orally active translocator protein 18 kDa (TSPO) antagonist with K i of 0.33-9.30 nM for rat and human TSPO . ONO-2952 is more selective for TSPO than other receptors, transporters, ion channels and enzymes. ONO-2952 exerts its anti-stress effects through inhibition of excessive activation of noradrenergic system in the brain without the amnesic effect. ONO-2952 has the potential for irritable bowel syndrome treatment

In Vitro

As for its selectivity for TSPO, ONO-2952 at a concentration of 10 μM showed good selectivity for TSPO against 98 off-targets (<50% inhibition). Determination of ONO-2952 K i or IC 50 values for the remaining 35 targets (50% inhibition at 10 μM) reveal K i values of less than 1 μM only for 3 receptors, i.e. melatonin 2, progesterone B, and adrenergic α2C. The affinity of ONO-2952 for these receptors is at least 59 times lower than that for TSPO. ONO-2952 K i value for the GABA A receptor is more than 600 times higher than that for TSPO. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

ONO-2952 (0.03-3 mg/kg; oral administration; male Sprague Dawley rats) treatment dose-dependently suppresses restraint stress-induced defecation in rats with brain TSPO occupancy of more than 50%. ONO-2952 also suppresses conditioned fear stress-induced freezing behavior in rats . ONO-2952 inhibits both neurosteroid accumulation and noradrenaline release in the brain of rats exposed to acute stress . MCE has not independently confirmed the accuracy of these methods. They are for reference only. Animal Model: Male Sprague Dawley rats (8 weeks old) under conditioned fear stress test Dosage: 0.03 mg/kg, 0.1 mg/kg, 0.3 mg/kg, 1 mg/kg, 3 mg/kg Administration: Oral administration Result: Dose-dependently suppressed restraint stress-induced defecation in rats. And suppressed conditioned fear stress-induced freezing behavior in rats.

Form:Solid

IC50& Target:Ki: 0.33-9.30 nM (Rat and human TSPO)

Especificaciones

Sinónimos
ONO-2952 | ONO 2952 | UNII-ZH8CPX4YNB | ETHANONE, 1-((1'S)-1'-(4-CHLORO-2-METHOXYPHENYL)-5'-FLUORO-1',2',3',9'-TETRAHYDROSPIRO(CYCLOPROPANE-1,4'-(4H)PYRIDO(3,4-B)INDOL)-2'-YL)- | MS-26749 | ZH8CPX4YNB | 1-((1S)-1-(4-CHLORO-2-METHOXYPHENYL)-5-FLUORO-1,9-DI
Especificaciones y pureza
≥99%
Mecanismos bioquímicos y fisiológicos
ONO-2952 is a potent, selective and orally active translocator protein 18 kDa (TSPO) antagonist with K i of 0.33-9.30 nM for rat and human TSPO . ONO-2952 is more selective for TSPO than other receptors, transporters, ion channels and enzymes. ONO-2952 ex
Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Tipo de acción
ANTAGONIST
Mecanismo de acción
Translocator protein antagonist
Pureza
≥99%
Propiedades del producto
ALogP
4.1
Nombres e identificadores
Sonrisas canónicas
CC(=O)N1CC2(CC2)C3=C([C@@H]1C4=C(C=C(C=C4)Cl)OC)NC5=C3C(=CC=C5)F
IUPAC Name
1-[(1S)-1-(4-chloro-2-methoxyphenyl)-5-fluorospiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,1'-cyclopropane]-2-yl]ethanone
InChIKey
ZBQMTQGDBFZUBG-NRFANRHFSA-N
INCHI
1S/C22H20ClFN2O2/c1-12(27)26-11-22(8-9-22)19-18-15(24)4-3-5-16(18)25-20(19)21(26)14-7-6-13(23)10-17(14)28-2/h3-7,10,21,25H,8-9,11H2,1-2H3/t21-/m0/s1
Isómeros SMILES
CC(=O)N1CC2(CC2)C3=C([C@@H]1C4=C(C=C(C=C4)Cl)OC)NC5=C3C(=CC=C5)F
PubChem CID
11524127
Peso molecular
398.86

Documentación

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Documento completo sobre peligros, manipulación, almacenamiento y cumplimiento normativo.

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✅ Certificado de análisis (COA)

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📊 Ficha técnica

Resumen de referencia rápida de las especificaciones y aplicaciones del producto.

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🔬 Hoja de especificaciones

Atributos de calidad completos y criterios de aceptación para esta calidad.

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Datos avanzados

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassAlkaloids and derivatives
ClaseHarmala alkaloids
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentHarmala alkaloids
Alternative Parents Beta carbolines  3-alkylindoles  Phenoxy compounds  Anisoles  Methoxybenzenes  Alkyl aryl ethers  Chlorobenzenes  Aryl chlorides  Aryl fluorides  Tertiary carboxylic acid amides  Acetamides  Pyrroles  Heteroaromatic compounds  Azacyclic compounds  Organochlorides  Organofluorides  Organic oxides  Carbonyl compounds  Hydrocarbon derivatives  Organonitrogen compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Harman - Beta-carboline - Pyridoindole - 3-alkylindole - Indole - Indole or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organofluoride - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as harmala alkaloids. These are compounds with a structure based on harmaline, harmine, harmalol, harman or a derivative of those parents. These parents are beta-carbolines, consisting of a pyrimidine fused to the pyrrole moiety of an indole to form a pyrido[3,4-b]indole.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SolubilidadDMSO : 180 mg/mL (451.29 mM; Need ultrasonic)
Peso molecular398.900 g/mol
XLogP34.100
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass398.12 Da
Monoisotopic Mass398.12 Da
Topological Polar Surface Area45.300 Ų
Heavy Atom Count28
Formal Charge0
Complexity630.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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